1-(4-chlorophenyl)-3-[5-(2-chlorophenyl)thiophen-2-yl]urea

Name: 1-(4-chlorophenyl)-3-[5-(2-chlorophenyl)thiophen-2-yl]urea — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₇H₁₂Cl₂N₂OS — CID 155436589

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC1-(4-chlorophenyl)-3-[5-(2-chlorophenyl)thiophen-2-yl]urea

SMILESO=C(Nc1ccc(Cl)cc1)Nc1ccc(-c2ccccc2Cl)s1

InChIInChI=1S/C17H12Cl2N2OS/c18-11-5-7-12(8-6-11)20-17(22)21-16-10-9-15(23-16)13-3-1-2-4-14(13)19/h1-10H,(H2,20,21,22)

InChIKeyIWZSXNAYGNWSMQ-UHFFFAOYSA-N

MW363.27 g/mol

LogP6.37

Rot. Bonds3

About 1-(4-chlorophenyl)-3-[5-(2-chlorophenyl)thiophen-2-yl]urea

1-(4-chlorophenyl)-3-[5-(2-chlorophenyl)thiophen-2-yl]urea (PubChem CID 155436589) has the molecular formula C₁₇H₁₂Cl₂N₂OS and a molecular weight of 363.27 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-3-[5-(2-chlorophenyl)thiophen-2-yl]urea.

Molecular Properties

Compound Name	1-(4-chlorophenyl)-3-[5-(2-chlorophenyl)thiophen-2-yl]urea
PubChem CID	155436589
Molecular Formula	C₁₇H₁₂Cl₂N₂OS
Molecular Weight	363.27 g/mol
Exact Mass	362.00
IUPAC Name	1-(4-chlorophenyl)-3-[5-(2-chlorophenyl)thiophen-2-yl]urea
SMILES	O=C(Nc1ccc(Cl)cc1)Nc1ccc(-c2ccccc2Cl)s1
InChI	InChI=1S/C17H12Cl2N2OS/c18-11-5-7-12(8-6-11)20-17(22)21-16-10-9-15(23-16)13-3-1-2-4-14(13)19/h1-10H,(H2,20,21,22)
InChIKey	IWZSXNAYGNWSMQ-UHFFFAOYSA-N
XLogP	6.37
TPSA	41.13 Å²
H-Bond Donors	2
H-Bond Acceptors	2
Rotatable Bonds	3
Heavy Atoms	23
Complexity	—

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	363.27
LogP ≤ 5	6.37
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-3-[5-(2-chlorophenyl)thiophen-2-yl]urea?

The IUPAC name of 1-(4-chlorophenyl)-3-[5-(2-chlorophenyl)thiophen-2-yl]urea (CID 155436589) is 1-(4-chlorophenyl)-3-[5-(2-chlorophenyl)thiophen-2-yl]urea.

What is the SMILES notation for 1-(4-chlorophenyl)-3-[5-(2-chlorophenyl)thiophen-2-yl]urea?

The canonical SMILES for 1-(4-chlorophenyl)-3-[5-(2-chlorophenyl)thiophen-2-yl]urea is O=C(Nc1ccc(Cl)cc1)Nc1ccc(-c2ccccc2Cl)s1.

What is the InChIKey of 1-(4-chlorophenyl)-3-[5-(2-chlorophenyl)thiophen-2-yl]urea?

The InChIKey is IWZSXNAYGNWSMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12Cl2N2OS/c18-11-5-7-12(8-6-11)20-17(22)21-16-10-9-15(23-16)13-3-1-2-4-14(13)19/h1-10H,(H2,20,21,22).

What are the key properties of 1-(4-chlorophenyl)-3-[5-(2-chlorophenyl)thiophen-2-yl]urea?

1-(4-chlorophenyl)-3-[5-(2-chlorophenyl)thiophen-2-yl]urea has a molecular weight of 363.27 g/mol, XLogP of 6.37, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(4-chlorophenyl)-3-[5-(2-chlorophenyl)thiophen-2-yl]urea is sourced from PubChem (CID 155436589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 155436589 — identifiers, structure, computed properties (public domain)

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